5-chloranyl-2-[[(3-ethanoylphenyl)amino]methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 5-chloranyl-2-[[(3-ethanoylphenyl)amino]methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-[(3-acetylanilino)methyl]-5-chloro-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[(3-acetylanilino)methyl]-5-chloro-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[(3-acetylanilino)methyl]-5-chloro-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-[(3-acetylanilino)methyl]-5-chloro-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C17H17ClN2O3 MolecularWeight: 332.78148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NCN2C(=O)C3CC=C(CC3C2=O)Cl

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NCN2C(=O)C3CC=C(CC3C2=O)Cl

InChI

InChI=1S/C17H17ClN2O3/c1-10(21)11-3-2-4-13(7-11)19-9-20-16(22)14-6-5-12(18)8-15(14)17(20)23/h2-5,7,14-15,19H,6,8-9H2,1H3